N-(4-ethoxyphenyl)-4-(2-methyl-1,3-thiazol-4-yl)benzamide

C19H18N2O2S — CID 892238

IUPACN-(4-ethoxyphenyl)-4-(2-methyl-1,3-thiazol-4-yl)benzamide
SMILESCCOc1ccc(NC(=O)c2ccc(-c3csc(C)n3)cc2)cc1
InChIInChI=1S/C19H18N2O2S/c1-3-23-17-10-8-16(9-11-17)21-19(22)15-6-4-14(5-7-15)18-12-24-13(2)20-18/h4-12H,3H2,1-2H3,(H,21,22)
InChIKeyZMAIZABGDFEPNW-UHFFFAOYSA-N
MW338.43 g/mol
LogP4.77
Rot. Bonds5

About N-(4-ethoxyphenyl)-4-(2-methyl-1,3-thiazol-4-yl)benzamide

N-(4-ethoxyphenyl)-4-(2-methyl-1,3-thiazol-4-yl)benzamide (PubChem CID 892238) has the molecular formula C19H18N2O2S and a molecular weight of 338.43 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)-4-(2-methyl-1,3-thiazol-4-yl)benzamide.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)-4-(2-methyl-1,3-thiazol-4-yl)benzamide
PubChem CID892238
Molecular FormulaC19H18N2O2S
Molecular Weight338.43 g/mol
Exact Mass338.11
IUPAC NameN-(4-ethoxyphenyl)-4-(2-methyl-1,3-thiazol-4-yl)benzamide
SMILESCCOc1ccc(NC(=O)c2ccc(-c3csc(C)n3)cc2)cc1
InChIInChI=1S/C19H18N2O2S/c1-3-23-17-10-8-16(9-11-17)21-19(22)15-6-4-14(5-7-15)18-12-24-13(2)20-18/h4-12H,3H2,1-2H3,(H,21,22)
InChIKeyZMAIZABGDFEPNW-UHFFFAOYSA-N
XLogP4.77
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.43
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)-4-(2-methyl-1,3-thiazol-4-yl)benzamide?
The IUPAC name of N-(4-ethoxyphenyl)-4-(2-methyl-1,3-thiazol-4-yl)benzamide (CID 892238) is N-(4-ethoxyphenyl)-4-(2-methyl-1,3-thiazol-4-yl)benzamide.
What is the SMILES notation for N-(4-ethoxyphenyl)-4-(2-methyl-1,3-thiazol-4-yl)benzamide?
The canonical SMILES for N-(4-ethoxyphenyl)-4-(2-methyl-1,3-thiazol-4-yl)benzamide is CCOc1ccc(NC(=O)c2ccc(-c3csc(C)n3)cc2)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)-4-(2-methyl-1,3-thiazol-4-yl)benzamide?
The InChIKey is ZMAIZABGDFEPNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O2S/c1-3-23-17-10-8-16(9-11-17)21-19(22)15-6-4-14(5-7-15)18-12-24-13(2)20-18/h4-12H,3H2,1-2H3,(H,21,22).
What are the key properties of N-(4-ethoxyphenyl)-4-(2-methyl-1,3-thiazol-4-yl)benzamide?
N-(4-ethoxyphenyl)-4-(2-methyl-1,3-thiazol-4-yl)benzamide has a molecular weight of 338.43 g/mol, XLogP of 4.77, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)-4-(2-methyl-1,3-thiazol-4-yl)benzamide is sourced from PubChem (CID 892238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).